Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21747409 | 0.98 | CES2 (0.34) | CES2CES1EPHX1HPGDHDAC8 | |
| SCHEMBL21980183 | 0.94 | LMNA (0.33) | CES2CES1HPGDALDH1A1LMNA | |
| SCHEMBL21747400 | 0.92 | LMNA (0.33) | HPGDALDH1A1LMNAPOLBUSP2 | |
| SCHEMBL13332473 | 0.77 | HPGD (0.53) | CES2CES1EPHX1HPGDHDAC8 | |
| SCHEMBL3990546 | 0.77 | HPGD (0.53) | CES2CES1EPHX1HPGDHDAC8 | |
| SCHEMBL5880920 | 0.74 | HPGD (0.50) | CES2CES1EPHX1HPGDALDH1A1 | |
| SCHEMBL12723334 | 0.73 | ALDH1A1 (0.42) | HPGDHTTALDH1A1TSHRLMNA | |
| SCHEMBL3986765 | 0.72 | CYP1A2 (0.45) | CES2CES1EPHX1HPGDNAAA | |
| SCHEMBL16270200 | 0.72 | CYP1A2 (0.45) | CES2CES1EPHX1HPGDNAAA | |
| SCHEMBL1088091 | 0.72 | CES2 (0.50) | CES2CES1EPHX1HDAC8HDAC6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113004271-A | Indolizine derivative and application thereof in medicine | 杭州安道药业有限公司 | 2021-06-22 | — | — | CN | disclosed |
| CN-108484598-B | Indolizine derivative and application thereof in medicine | 杭州安道药业有限公司 | 2021-03-02 | — | — | CN | disclosed |